1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine

C14H17NO — CID 61065426

IUPAC1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine
SMILESCNC(Cc1ccc(C)cc1)c1ccoc1
InChIInChI=1S/C14H17NO/c1-11-3-5-12(6-4-11)9-14(15-2)13-7-8-16-10-13/h3-8,10,14-15H,9H2,1-2H3
InChIKeyXAFJBSJWTIBMSI-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.09
Rot. Bonds4

About 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine

1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine (PubChem CID 61065426) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine
PubChem CID61065426
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine
SMILESCNC(Cc1ccc(C)cc1)c1ccoc1
InChIInChI=1S/C14H17NO/c1-11-3-5-12(6-4-11)9-14(15-2)13-7-8-16-10-13/h3-8,10,14-15H,9H2,1-2H3
InChIKeyXAFJBSJWTIBMSI-UHFFFAOYSA-N
XLogP3.09
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(5-methylfuran-3-yl)-2-(4-methylphenyl)ethanamine
CID 114821279
1-(3,5-dimethylphenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 61065954
[2-(4-ethylphenyl)-1-(furan-3-yl)ethyl]hydrazine
CID 105221214
1-(furan-3-yl)-N-methyl-2-methylsulfanylethanamine
CID 63949401
1-(3,5-dichlorophenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 63526721
1-(4-bromo-3,5-dimethylphenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 114330447
1-(4-fluorophenyl)-2-(furan-3-yl)-N-methylethanamine
CID 83176188
N-methyl-2-(4-methylphenyl)-1-(5-methylthiophen-3-yl)ethanamine
CID 65104510
1-(1,3-benzodioxol-5-yl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 61064188
1-(4-bromo-3-methylphenyl)-2-(furan-3-yl)-N-methylethanamine
CID 105030035
1-(furan-3-yl)-3-(4-methylphenyl)propan-2-ol
CID 83171853
2-(3-chloro-2-fluorophenyl)-1-(furan-3-yl)-N-methylethanamine
CID 82806792

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine?
The IUPAC name of 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine (CID 61065426) is 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine.
What is the SMILES notation for 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine?
The canonical SMILES for 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine is CNC(Cc1ccc(C)cc1)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine?
The InChIKey is XAFJBSJWTIBMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-11-3-5-12(6-4-11)9-14(15-2)13-7-8-16-10-13/h3-8,10,14-15H,9H2,1-2H3.
What are the key properties of 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine?
1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine has a molecular weight of 215.30 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-N-methyl-2-(4-methylphenyl)ethanamine is sourced from PubChem (CID 61065426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).